Chemical ID: 6686538

CCCOCC(C)O
Chemical ID:
6686538
Name [?]:
1-propoxypropan-2-ol
SMILES [?]:
CCCOCC(C)O
InChi [?]:
InChI=1/C6H14O2/c1-3-4-8-5-6(2)7/h6-7H,3-5H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,2,3,5,6,8,4/rA:8cCCCOCCCO/rB:s1;s2;s3;s4;s5;s6;s6;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C6H14O2
All Atoms:8
Heavy Atoms:8
Chiral Atoms:1
ZAP Information [?]
Total:3.96737
Area:297.246
Solvation:-3.46377
Coulombic:-24.4133
Bond Count [?]
All:7
Single:7
Double:0
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:118.174
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.55
LogP (Chemaxon):0.79

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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